SchNet - a deep learning architecture for quantum chemistry

SchNetPack - Deep Neural Networks for Atomistic Systems

English learning for Mandarin native speakers

🌈 Photonica is made for VS code. Its soft colors will be helpful for you to get inspired.

A guide to owl taxonomy, rescue and feeding

QuTiP: Quantum Toolbox in Python

🎉 This repository is used to collect and express thoughts, it can also be regarded as my personal home page or blog.

🎐Parser and plotting library for VASP.

Simulation of atom-light interaction

A CLI written in Go language that writes git commit messages or do a code review brief for you using ChatGPT AI (gpt-4o, gpt-4-turbo, gpt-3.5-turbo model) and automatically installs a git prepare-c…

Linux Kernel for Surface Devices

3D plotting and mesh analysis through a streamlined interface for the Visualization Toolkit (VTK)

🦊 Soothing pastel icons for VSCode/VSCodium

Use 3D visualization software Mayavi to visualize VASP POSCAR file.

K3D lets you create 3D plots backed by WebGL with high-level API (surfaces, isosurfaces, voxels, mesh, cloud points, vtk objects, volume renderer, colormaps, etc). The primary aim of K3D-jupyter is…

Provide Eigen3 to numpy conversion

BLAS-like Library Instantiation Software Framework

Plot band structures from VASP band calculation with matplotlib

🧊 A Note on Statistical Physics

My handwritten lecture notes.

A special repository which demonstrates myself.

VASP practice

Physics Lover

Semiemperical quasiharmonic thermal elasticity

Translation of `Physics from Symmetry'.

BEM solver for Maxwell equations

Python Materials Genomics (pymatgen) is a robust materials analysis code that defines classes for structures and molecules with support for many electronic structure codes. It powers the Materials …

band plot using python matplotlib